SCHEMBL548100

SCHEMBL548100

Cc1nccnc1C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 5/20 0.45
PTGS2 P35354 5/20 0.36
PTGS1 P23219 1/20 0.35
CACNA2D1 P54289 1/20 0.35
CYP11B2 P19099 1/20 0.34
PSMB5 P28074 1/20 0.34
CHRM4 P08173 2/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
FFAR2 O15552 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21150251 0.89 OPRL1 (0.53) OPRL1CACNA2D1CHRM4KDM4E
SCHEMBL2355700 0.84 CYP11B2 (0.40) OPRL1CYP11B2JAK2JAK1TYK2
SCHEMBL10456695 0.75 KDM5B (0.40) OPRL1PTGS2PTGS1CACNA2D1PSMB5
SCHEMBL17432910 0.75 HRH2 (0.38) PTGS2PTGS1PSMB5CHRM4JAK2
SCHEMBL11680081 0.74 CYP11B2 (0.34) OPRL1CYP11B2JAK2JAK1TYK2
SCHEMBL28563124 0.74 TDO2 (0.37) CYP11B2JAK2JAK1TYK2JAK3
SCHEMBL11679373 0.74 OPRL1 (0.37) OPRL1CYP11B2JAK2JAK1TYK2
SCHEMBL15744792 0.74 CHRNB2 (0.42) OPRL1
SCHEMBL7937826 0.74 NISCH (0.36) OPRL1CYP11B2JAK2JAK1TYK2
SCHEMBL12818351 0.74 OPRL1 (0.61) OPRL1CYP11B2KDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 132 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4380993-A1 AMINE COMPOSITION, EPOXY SYSTEM PREPARED FROM THE AMINE COMPOSITION AND AN EPOXY RESIN, AND USE OF THE EPOXY SYSTEM Evonik Operations GmbH (DE) 2024-06-12 EP claimed
CN-117794975-A Amine composition, epoxy system made of the amine composition and epoxy resin, and use of the epoxy system 赢创运营有限公司 2024-03-29 CN claimed
CN-117504946-A Method for continuously removing adsorbed water of TDA hydrogenation catalyst 四川新阳新材料有限责任公司 2024-02-06 CN claimed
CN-117486731-A Method for inhibiting deamination side reaction of methyl cyclohexanediamine prepared by hydrogenation of diaminotoluene 四川新阳新材料有限责任公司 2024-02-02 CN claimed
CN-117487136-A Water-soluble alicyclic amine curing agent and preparation method thereof 江苏富琪森新材料有限公司 2024-02-02 CN claimed
CN-113631624-B Curing agent composition for epoxy resin compounds, epoxy resin compounds with improved low temperature curing and multicomponent epoxy resin systems 喜利得股份公司 2023-10-20 CN claimed
EP-4219585-A1 MONO-ALKYLATED DIAMINES FOR EPOXY FORMULATIONS: NOVEL CURING AGENTS FOR EPOXY SYSTEMS Evonik Operations GmbH (DE) 2023-08-02 EP claimed
WO-2023010442-A1 AMINE COMPOSITION, EPOXY SYSTEM PREPARED FROM THE AMINE COMPOSITION AND AN EPOXY RESIN, AND USE OF THE EPOXY SYSTEM EVONIK OPERATIONS GMBH (DE) 2023-02-09 WO claimed
US-11472913-B2 Mono-alkylated diamines for epoxy formulations: novel curing agents for epoxy systems EVONIK OPERATIONS GMBH (DE) 2022-10-18 US claimed
CN-113631624-A Curing agent composition for epoxy resin compounds, epoxy resin compounds with improved low temperature cure, and multi-component epoxy resin systems 喜利得股份公司 2021-11-09 CN claimed
US-20190241501-A1 PROCESS FOR HYDROGENATING TOLUENEDIAMINE (TDA) TAR BASF SE (DE) 2019-08-08 US claimed
WO-2018069209-A1 PROCESS FOR HYDROGENATING TOLUENEDIAMINE (TDA) TAR BASF SE (DE) 2018-04-19 WO claimed
WO-2009131692-A1 SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2009-10-29 WO claimed
US-6902679-B2 Treatment of water containing organic wastes with aromatic amine nitrate salts AIR PRODUCTS AND CHEMICALS, INC. (US) 2005-06-07 US claimed
US-20030066806-A1 Treatment of water containing organic wastes with aromatic amine nitrate salts AIR PRODUCTS AND CHEMICALS, INC 2003-04-10 US claimed
CN-1398794-A Treatment of water containing waste organic matter with nitrate of aromatic amine AIR PROD & CHEM (US) 2003-02-26 CN claimed
CN-1382645-A Utilizing aromatic ammonium nitrate salt for treatment of water contg. organic refuse AIR PROD & CHEM (US) 2002-12-04 CN claimed
EP-1243563-A2 Treatment of water containing organic wastes with aromatic amine nitrate salts AIR PRODUCTS AND CHEMICALS, INC. (US) 2002-09-25 EP claimed
EP-1243562-A2 Treatment of water containing organic wastes with aromatic amine nitrate salts AIR PRODUCTS AND CHEMICALS, INC. (US) 2002-09-25 EP claimed
US-6379562-B1 WET OXIDATION; CORROSION RESISTANCE ATR PRODUCTS AND CHEMICALS, INC. 2002-04-30 US claimed